IID

O95069_Q68DU8.1 contacts (residues)

Receptor	R: Secondary Structure	R: Residue	R; Chain	R: Residue number	Ligand	L: Secondary Structure	L: Residue	L: Chain	L: Residue Number
R	-	PHE	A	100	L	-	LEU	V	396
R	H	LYS	A	103	L	-	PRO	V	397
R	-	THR	A	123	L	-	LEU	V	399
R	-	PRO	A	124	L	-	PRO	V	397
R	-	PRO	A	124	L	-	PRO	V	398
R	-	PRO	A	124	L	-	LEU	V	399
R	-	ASP	A	125	L	-	PRO	V	398
R	-	ASP	A	125	L	-	LEU	V	399
R	-	ASP	A	125	L	-	LEU	V	400
R	-	ASP	A	125	L	-	LYS	V	401
R	-	ILE	A	127	L	-	LEU	V	400
R	-	ILE	A	127	L	-	LYS	V	401
R	-	ILE	A	127	L	-	THR	V	402
R	-	LYS	A	128	L	-	LYS	V	401
R	-	LYS	A	128	L	-	THR	V	402
R	-	LYS	A	128	L	-	GLU	V	403
R	-	LYS	A	128	L	-	SER	V	404
R	-	SER	A	130	L	-	GLU	V	403
R	-	ASP	A	132	L	H	ARG	V	344
R	-	PHE	A	134	L	H	ILE	V	351
R	-	CYS	A	135	L	H	PHE	V	355
R	-	HIS	A	136	L	H	LYS	V	354
R	-	SER	A	137	L	H	ALA	V	358
R	-	ASP	A	138	L	H	ALA	V	358
R	-	ASP	A	138	L	H	ILE	V	361
R	-	PHE	A	139	L	H	ILE	V	361
R	-	PHE	A	139	L	H	LEU	V	365
R	-	GLU	A	140	L	H	ILE	V	361
R	-	GLU	A	140	L	H	LEU	V	365
R	-	ASP	A	141	L	H	LEU	V	365
R	-	ALA	A	142	L	H	LEU	V	365
R	-	SER	A	143	L	-	GLU	V	368
R	-	SER	A	143	L	-	LEU	V	369
R	-	GLN	A	144	L	-	GLU	V	368
R	-	GLN	A	144	L	-	ASN	V	372
R	-	GLY	A	145	L	-	GLU	V	368
R	-	GLY	A	145	L	-	LEU	V	369
R	-	GLY	A	145	L	-	ALA	V	370
R	-	SER	A	146	L	-	LEU	V	369
R	-	SER	A	146	L	-	ALA	V	370
R	-	SER	A	146	L	-	GLY	V	371
R	-	ASP	A	147	L	-	LEU	V	369
R	-	ASP	A	147	L	-	ALA	V	370
R	-	ASP	A	147	L	-	GLY	V	371
R	-	THR	A	148	L	-	LEU	V	369
R	-	THR	A	148	L	-	ALA	V	370
R	-	ILE	A	150	L	H	SER	V	366
R	-	ILE	A	150	L	H	ALA	V	367
R	-	ASP	A	160	L	-	LYS	V	401
R	-	TRP	A	163	L	-	ASP	V	394
R	-	TRP	A	163	L	-	VAL	V	395
R	-	TRP	A	163	L	-	LEU	V	396
R	S	PHE	A	165	L	-	GLU	V	392
R	S	THR	A	167	L	-	THR	V	390
R	S	ARG	A	171	L	-	LEU	V	384
R	S	ARG	A	171	L	-	VAL	V	386
R	S	CYS	A	195	L	-	HIS	V	388
R	S	CYS	A	195	L	-	LEU	V	389
R	S	CYS	A	195	L	-	THR	V	390
R	H	GLU	A	207	L	H	ARG	V	363
R	-	TYR	A	222	L	-	GLU	V	392
R	-	SER	A	224	L	-	ASN	V	387
R	-	SER	A	224	L	-	HIS	V	388
R	-	SER	A	224	L	-	LEU	V	389
R	-	ARG	A	225	L	-	SER	V	385
R	-	ARG	A	225	L	-	ASN	V	387
R	S	TYR	A	271	L	-	HIS	V	388
R	S	TYR	A	271	L	-	LEU	V	389
R	S	GLU	A	273	L	-	LEU	V	389
R	-	TRP	A	283	L	-	LEU	V	400
R	-	HIS	A	99	L	-	ASP	V	394
R	-	HIS	A	99	L	-	VAL	V	395
R	-	HIS	A	99	L	-	LEU	V	396

- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
- In the Secondary Structure columns: 'H' means that residues in that row are part of Alpha Helix; 'S' - Beta Sheet

O95069_Q68DU8.1 contacts (residues & atoms)

Receptor	R: Secondary Structure	R: Atom	R: Residue	R; Chain	R: Residue number	Ligand	L: Secondary Structure	L; Atom	L: Residue	L: Chain	L: Residue Number
R	-	N	HIS	A	99	L	-	CD1	LEU	V	396
R	-	N	HIS	A	99	L	-	HD12	LEU	V	396
R	-	N	HIS	A	99	L	-	HD13	LEU	V	396
R	-	CA	HIS	A	99	L	-	CG1	VAL	V	395
R	-	CA	HIS	A	99	L	-	HG11	VAL	V	395
R	-	CA	HIS	A	99	L	-	HG13	VAL	V	395
R	-	CA	HIS	A	99	L	-	CD1	LEU	V	396
R	-	CA	HIS	A	99	L	-	HD11	LEU	V	396
R	-	CA	HIS	A	99	L	-	HD12	LEU	V	396
R	-	CA	HIS	A	99	L	-	HD13	LEU	V	396
R	-	C	HIS	A	99	L	-	HG11	VAL	V	395
R	-	C	HIS	A	99	L	-	HG13	VAL	V	395
R	-	C	HIS	A	99	L	-	HD12	LEU	V	396
R	-	CB	HIS	A	99	L	-	CG1	VAL	V	395
R	-	CB	HIS	A	99	L	-	HG11	VAL	V	395
R	-	CB	HIS	A	99	L	-	HG13	VAL	V	395
R	-	CB	HIS	A	99	L	-	HD13	LEU	V	396
R	-	O	HIS	A	99	L	-	HG11	VAL	V	395
R	-	O	HIS	A	99	L	-	HG13	VAL	V	395
R	-	CG	HIS	A	99	L	-	O	VAL	V	395
R	-	CG	HIS	A	99	L	-	HB	VAL	V	395
R	-	CG	HIS	A	99	L	-	HG11	VAL	V	395
R	-	CG	HIS	A	99	L	-	HG13	VAL	V	395
R	-	CG	HIS	A	99	L	-	HD13	LEU	V	396
R	-	ND1	HIS	A	99	L	-	HB3	ASP	V	394
R	-	ND1	HIS	A	99	L	-	C	VAL	V	395
R	-	ND1	HIS	A	99	L	-	CB	VAL	V	395
R	-	ND1	HIS	A	99	L	-	O	VAL	V	395
R	-	ND1	HIS	A	99	L	-	CG1	VAL	V	395
R	-	ND1	HIS	A	99	L	-	HB	VAL	V	395
R	-	ND1	HIS	A	99	L	-	HG11	VAL	V	395
R	-	ND1	HIS	A	99	L	-	HG13	VAL	V	395
R	-	ND1	HIS	A	99	L	-	CD1	LEU	V	396
R	-	ND1	HIS	A	99	L	-	HD11	LEU	V	396
R	-	ND1	HIS	A	99	L	-	HD13	LEU	V	396
R	-	CE1	HIS	A	99	L	-	CG	ASP	V	394
R	-	CE1	HIS	A	99	L	-	OD2	ASP	V	394
R	-	CE1	HIS	A	99	L	-	HB3	ASP	V	394
R	-	CE1	HIS	A	99	L	-	O	VAL	V	395
R	-	CE1	HIS	A	99	L	-	HD13	LEU	V	396
R	-	NE2	HIS	A	99	L	-	OD2	ASP	V	394
R	-	N	PHE	A	100	L	-	HD12	LEU	V	396
R	H	CD	LYS	A	103	L	-	HG2	PRO	V	397
R	H	NZ	LYS	A	103	L	-	CG	PRO	V	397
R	H	NZ	LYS	A	103	L	-	HG2	PRO	V	397
R	H	NZ	LYS	A	103	L	-	HG3	PRO	V	397
R	-	O	THR	A	123	L	-	HD21	LEU	V	399
R	-	O	THR	A	123	L	-	HD22	LEU	V	399
R	-	CA	PRO	A	124	L	-	HB2	PRO	V	397
R	-	CA	PRO	A	124	L	-	O	PRO	V	398
R	-	CA	PRO	A	124	L	-	HA	LEU	V	399
R	-	C	PRO	A	124	L	-	O	PRO	V	398
R	-	C	PRO	A	124	L	-	HA	LEU	V	399
R	-	CB	PRO	A	124	L	-	CB	PRO	V	397
R	-	CB	PRO	A	124	L	-	HB2	PRO	V	397
R	-	CB	PRO	A	124	L	-	HG3	PRO	V	397
R	-	CB	PRO	A	124	L	-	O	PRO	V	398
R	-	CB	PRO	A	124	L	-	HD3	PRO	V	398
R	-	CG	PRO	A	124	L	-	CB	PRO	V	397
R	-	CG	PRO	A	124	L	-	HB2	PRO	V	397
R	-	N	ASP	A	125	L	-	O	PRO	V	398
R	-	N	ASP	A	125	L	-	CD2	LEU	V	399
R	-	N	ASP	A	125	L	-	HA	LEU	V	399
R	-	N	ASP	A	125	L	-	HD21	LEU	V	399
R	-	N	ASP	A	125	L	-	H	LEU	V	400
R	-	CA	ASP	A	125	L	-	HA	LEU	V	399
R	-	CA	ASP	A	125	L	-	HD21	LEU	V	399
R	-	CA	ASP	A	125	L	-	H	LEU	V	400
R	-	C	ASP	A	125	L	-	O	PRO	V	398
R	-	C	ASP	A	125	L	-	HA	LEU	V	399
R	-	C	ASP	A	125	L	-	H	LEU	V	400
R	-	CB	ASP	A	125	L	-	HA	LEU	V	399
R	-	CB	ASP	A	125	L	-	HD21	LEU	V	399
R	-	CB	ASP	A	125	L	-	N	LEU	V	400
R	-	CB	ASP	A	125	L	-	CA	LEU	V	400
R	-	CB	ASP	A	125	L	-	H	LEU	V	400
R	-	CB	ASP	A	125	L	-	HA	LEU	V	400
R	-	CB	ASP	A	125	L	-	H	LYS	V	401
R	-	O	ASP	A	125	L	-	C	PRO	V	398
R	-	O	ASP	A	125	L	-	O	PRO	V	398
R	-	O	ASP	A	125	L	-	CA	LEU	V	399
R	-	O	ASP	A	125	L	-	C	LEU	V	399
R	-	O	ASP	A	125	L	-	HA	LEU	V	399
R	-	O	ASP	A	125	L	-	N	LEU	V	400
R	-	O	ASP	A	125	L	-	H	LEU	V	400
R	-	CG	ASP	A	125	L	-	HD21	LEU	V	399
R	-	CG	ASP	A	125	L	-	H	LEU	V	400
R	-	CG	ASP	A	125	L	-	HA	LEU	V	400
R	-	OD2	ASP	A	125	L	-	CD2	LEU	V	399
R	-	OD2	ASP	A	125	L	-	HD21	LEU	V	399
R	-	OD2	ASP	A	125	L	-	HD22	LEU	V	399
R	-	OD2	ASP	A	125	L	-	HD23	LEU	V	399
R	-	OD2	ASP	A	125	L	-	H	LEU	V	400
R	-	OD2	ASP	A	125	L	-	HA	LEU	V	400
R	-	OD2	ASP	A	125	L	-	HG	LEU	V	400
R	-	OD2	ASP	A	125	L	-	HD21	LEU	V	400
R	-	N	ILE	A	127	L	-	O	LYS	V	401
R	-	N	ILE	A	127	L	-	H	LYS	V	401
R	-	CA	ILE	A	127	L	-	C	LYS	V	401
R	-	CA	ILE	A	127	L	-	O	LYS	V	401
R	-	CA	ILE	A	127	L	-	H	LYS	V	401
R	-	C	ILE	A	127	L	-	O	LYS	V	401
R	-	CB	ILE	A	127	L	-	N	LYS	V	401
R	-	CB	ILE	A	127	L	-	C	LYS	V	401
R	-	CB	ILE	A	127	L	-	O	LYS	V	401
R	-	CB	ILE	A	127	L	-	H	LYS	V	401
R	-	CB	ILE	A	127	L	-	HB2	LYS	V	401
R	-	CG1	ILE	A	127	L	-	C	LEU	V	400
R	-	CG1	ILE	A	127	L	-	O	LEU	V	400
R	-	CG1	ILE	A	127	L	-	N	LYS	V	401
R	-	CG1	ILE	A	127	L	-	CA	LYS	V	401
R	-	CG1	ILE	A	127	L	-	C	LYS	V	401
R	-	CG1	ILE	A	127	L	-	CB	LYS	V	401
R	-	CG1	ILE	A	127	L	-	O	LYS	V	401
R	-	CG1	ILE	A	127	L	-	H	LYS	V	401
R	-	CG1	ILE	A	127	L	-	HB2	LYS	V	401
R	-	CG2	ILE	A	127	L	-	CA	LYS	V	401
R	-	CG2	ILE	A	127	L	-	C	LYS	V	401
R	-	CG2	ILE	A	127	L	-	O	LYS	V	401
R	-	CG2	ILE	A	127	L	-	HB2	LYS	V	401
R	-	CG2	ILE	A	127	L	-	HB3	LYS	V	401
R	-	CG2	ILE	A	127	L	-	N	THR	V	402
R	-	CG2	ILE	A	127	L	-	H	THR	V	402
R	-	CD1	ILE	A	127	L	-	C	LEU	V	400
R	-	CD1	ILE	A	127	L	-	O	LEU	V	400
R	-	CD1	ILE	A	127	L	-	N	LYS	V	401
R	-	CD1	ILE	A	127	L	-	CA	LYS	V	401
R	-	CD1	ILE	A	127	L	-	CB	LYS	V	401
R	-	CD1	ILE	A	127	L	-	O	LYS	V	401
R	-	CD1	ILE	A	127	L	-	H	LYS	V	401
R	-	CD1	ILE	A	127	L	-	HB2	LYS	V	401
R	-	N	LYS	A	128	L	-	O	LYS	V	401
R	-	N	LYS	A	128	L	-	H	THR	V	402
R	-	C	LYS	A	128	L	-	O	THR	V	402
R	-	C	LYS	A	128	L	-	H	THR	V	402
R	-	CB	LYS	A	128	L	-	O	GLU	V	403
R	-	O	LYS	A	128	L	-	O	THR	V	402
R	-	O	LYS	A	128	L	-	H	THR	V	402
R	-	O	LYS	A	128	L	-	O	GLU	V	403
R	-	CG	LYS	A	128	L	-	O	GLU	V	403
R	-	CD	LYS	A	128	L	-	O	GLU	V	403
R	-	CD	LYS	A	128	L	-	H	SER	V	404
R	-	CB	SER	A	130	L	-	OE2	GLU	V	403
R	-	CB	SER	A	130	L	-	HB2	GLU	V	403
R	-	CB	SER	A	130	L	-	HB3	GLU	V	403
R	-	OG	SER	A	130	L	-	CB	GLU	V	403
R	-	OG	SER	A	130	L	-	CD	GLU	V	403
R	-	OG	SER	A	130	L	-	OE2	GLU	V	403
R	-	OG	SER	A	130	L	-	HB2	GLU	V	403
R	-	OG	SER	A	130	L	-	HB3	GLU	V	403
R	-	CG	ASP	A	132	L	H	HH21	ARG	V	344
R	-	OD2	ASP	A	132	L	H	NH2	ARG	V	344
R	-	OD2	ASP	A	132	L	H	HE	ARG	V	344
R	-	OD2	ASP	A	132	L	H	HH21	ARG	V	344
R	-	OD2	ASP	A	132	L	H	HH22	ARG	V	344
R	-	CB	PHE	A	134	L	H	HG22	ILE	V	351
R	-	CB	PHE	A	134	L	H	HD12	ILE	V	351
R	-	CG	PHE	A	134	L	H	HD12	ILE	V	351
R	-	CD2	PHE	A	134	L	H	CG1	ILE	V	351
R	-	CD2	PHE	A	134	L	H	CG2	ILE	V	351
R	-	CD2	PHE	A	134	L	H	CD1	ILE	V	351
R	-	CD2	PHE	A	134	L	H	HG12	ILE	V	351
R	-	CD2	PHE	A	134	L	H	HG22	ILE	V	351
R	-	CD2	PHE	A	134	L	H	HG23	ILE	V	351
R	-	CD2	PHE	A	134	L	H	HD11	ILE	V	351
R	-	CD2	PHE	A	134	L	H	HD12	ILE	V	351
R	-	CE2	PHE	A	134	L	H	CG1	ILE	V	351
R	-	CE2	PHE	A	134	L	H	CD1	ILE	V	351
R	-	CE2	PHE	A	134	L	H	HG12	ILE	V	351
R	-	CE2	PHE	A	134	L	H	HG23	ILE	V	351
R	-	CE2	PHE	A	134	L	H	HD11	ILE	V	351
R	-	CE2	PHE	A	134	L	H	HD12	ILE	V	351
R	-	O	CYS	A	135	L	H	HD2	PHE	V	355
R	-	O	CYS	A	135	L	H	HE2	PHE	V	355
R	-	CE1	HIS	A	136	L	H	HD3	LYS	V	354
R	-	O	SER	A	137	L	H	HB1	ALA	V	358
R	-	CG	ASP	A	138	L	H	HB3	ALA	V	358
R	-	OD1	ASP	A	138	L	H	CA	ALA	V	358
R	-	OD1	ASP	A	138	L	H	CB	ALA	V	358
R	-	OD1	ASP	A	138	L	H	HA	ALA	V	358
R	-	OD1	ASP	A	138	L	H	HB1	ALA	V	358
R	-	OD1	ASP	A	138	L	H	HB3	ALA	V	358
R	-	OD1	ASP	A	138	L	H	HD12	ILE	V	361
R	-	C	PHE	A	139	L	H	HG22	ILE	V	361
R	-	O	PHE	A	139	L	H	HG21	ILE	V	361
R	-	O	PHE	A	139	L	H	HG22	ILE	V	361
R	-	O	PHE	A	139	L	H	HD13	LEU	V	365
R	-	N	GLU	A	140	L	H	HG22	ILE	V	361
R	-	CA	GLU	A	140	L	H	HG22	ILE	V	361
R	-	CA	GLU	A	140	L	H	HD13	LEU	V	365
R	-	C	GLU	A	140	L	H	HD13	LEU	V	365
R	-	CG	GLU	A	140	L	H	HD13	ILE	V	361
R	-	CD	GLU	A	140	L	H	HD13	ILE	V	361
R	-	OE1	GLU	A	140	L	H	CG1	ILE	V	361
R	-	OE1	GLU	A	140	L	H	CD1	ILE	V	361
R	-	OE1	GLU	A	140	L	H	HG12	ILE	V	361
R	-	OE1	GLU	A	140	L	H	HG22	ILE	V	361
R	-	OE1	GLU	A	140	L	H	HG23	ILE	V	361
R	-	OE1	GLU	A	140	L	H	HD11	ILE	V	361
R	-	OE1	GLU	A	140	L	H	HD13	ILE	V	361
R	-	N	ASP	A	141	L	H	CD1	LEU	V	365
R	-	N	ASP	A	141	L	H	HD12	LEU	V	365
R	-	N	ASP	A	141	L	H	HD13	LEU	V	365
R	-	N	ASP	A	141	L	H	HD22	LEU	V	365
R	-	CA	ASP	A	141	L	H	HD22	LEU	V	365
R	-	C	ASP	A	141	L	H	CD2	LEU	V	365
R	-	C	ASP	A	141	L	H	HD21	LEU	V	365
R	-	C	ASP	A	141	L	H	HD22	LEU	V	365
R	-	C	ASP	A	141	L	H	HD23	LEU	V	365
R	-	O	ASP	A	141	L	H	CG	LEU	V	365
R	-	O	ASP	A	141	L	H	CD1	LEU	V	365
R	-	O	ASP	A	141	L	H	CD2	LEU	V	365
R	-	O	ASP	A	141	L	H	HD12	LEU	V	365
R	-	O	ASP	A	141	L	H	HD13	LEU	V	365
R	-	O	ASP	A	141	L	H	HD21	LEU	V	365
R	-	O	ASP	A	141	L	H	HD22	LEU	V	365
R	-	O	ASP	A	141	L	H	HD23	LEU	V	365
R	-	N	ALA	A	142	L	H	CD2	LEU	V	365
R	-	N	ALA	A	142	L	H	HD22	LEU	V	365
R	-	N	ALA	A	142	L	H	HD23	LEU	V	365
R	-	CA	ALA	A	142	L	H	CD2	LEU	V	365
R	-	CA	ALA	A	142	L	H	HD21	LEU	V	365
R	-	CA	ALA	A	142	L	H	HD22	LEU	V	365
R	-	CA	ALA	A	142	L	H	HD23	LEU	V	365
R	-	C	SER	A	143	L	-	HD11	LEU	V	369
R	-	O	SER	A	143	L	-	HB2	GLU	V	368
R	-	O	SER	A	143	L	-	HB3	GLU	V	368
R	-	O	SER	A	143	L	-	CD1	LEU	V	369
R	-	O	SER	A	143	L	-	HD11	LEU	V	369
R	-	O	SER	A	143	L	-	HD12	LEU	V	369
R	-	O	SER	A	143	L	-	HD13	LEU	V	369
R	-	CA	GLN	A	144	L	-	O	GLU	V	368
R	-	CA	GLN	A	144	L	-	HB3	GLU	V	368
R	-	C	GLN	A	144	L	-	O	GLU	V	368
R	-	OE1	GLN	A	144	L	-	HD22	ASN	V	372
R	-	N	GLY	A	145	L	-	C	GLU	V	368
R	-	N	GLY	A	145	L	-	O	GLU	V	368
R	-	N	GLY	A	145	L	-	HA	LEU	V	369
R	-	CA	GLY	A	145	L	-	O	GLU	V	368
R	-	CA	GLY	A	145	L	-	HA	LEU	V	369
R	-	C	GLY	A	145	L	-	O	GLU	V	368
R	-	C	GLY	A	145	L	-	CA	LEU	V	369
R	-	C	GLY	A	145	L	-	C	LEU	V	369
R	-	C	GLY	A	145	L	-	O	LEU	V	369
R	-	C	GLY	A	145	L	-	HA	LEU	V	369
R	-	O	GLY	A	145	L	-	O	GLU	V	368
R	-	O	GLY	A	145	L	-	CA	LEU	V	369
R	-	O	GLY	A	145	L	-	C	LEU	V	369
R	-	O	GLY	A	145	L	-	CB	LEU	V	369
R	-	O	GLY	A	145	L	-	O	LEU	V	369
R	-	O	GLY	A	145	L	-	HA	LEU	V	369
R	-	O	GLY	A	145	L	-	HG	LEU	V	369
R	-	O	GLY	A	145	L	-	N	ALA	V	370
R	-	N	SER	A	146	L	-	C	LEU	V	369
R	-	N	SER	A	146	L	-	O	LEU	V	369
R	-	N	SER	A	146	L	-	HA	LEU	V	369
R	-	N	SER	A	146	L	-	N	ALA	V	370
R	-	CA	SER	A	146	L	-	O	LEU	V	369
R	-	CA	SER	A	146	L	-	HA	ALA	V	370
R	-	C	SER	A	146	L	-	C	LEU	V	369
R	-	C	SER	A	146	L	-	O	LEU	V	369
R	-	C	SER	A	146	L	-	N	ALA	V	370
R	-	C	SER	A	146	L	-	CA	ALA	V	370
R	-	C	SER	A	146	L	-	C	ALA	V	370
R	-	C	SER	A	146	L	-	O	ALA	V	370
R	-	C	SER	A	146	L	-	HA	ALA	V	370
R	-	C	SER	A	146	L	-	N	GLY	V	371
R	-	O	SER	A	146	L	-	C	LEU	V	369
R	-	O	SER	A	146	L	-	O	LEU	V	369
R	-	O	SER	A	146	L	-	N	ALA	V	370
R	-	O	SER	A	146	L	-	CA	ALA	V	370
R	-	O	SER	A	146	L	-	HA	ALA	V	370
R	-	N	ASP	A	147	L	-	O	LEU	V	369
R	-	N	ASP	A	147	L	-	N	ALA	V	370
R	-	N	ASP	A	147	L	-	CA	ALA	V	370
R	-	N	ASP	A	147	L	-	C	ALA	V	370
R	-	N	ASP	A	147	L	-	O	ALA	V	370
R	-	N	ASP	A	147	L	-	HA	ALA	V	370
R	-	N	ASP	A	147	L	-	N	GLY	V	371
R	-	N	ASP	A	147	L	-	CA	GLY	V	371
R	-	N	ASP	A	147	L	-	H	GLY	V	371
R	-	N	ASP	A	147	L	-	HA2	GLY	V	371
R	-	CA	ASP	A	147	L	-	CA	ALA	V	370
R	-	CA	ASP	A	147	L	-	C	ALA	V	370
R	-	CA	ASP	A	147	L	-	O	ALA	V	370
R	-	CA	ASP	A	147	L	-	HA	ALA	V	370
R	-	CA	ASP	A	147	L	-	HA2	GLY	V	371
R	-	C	ASP	A	147	L	-	CA	ALA	V	370
R	-	C	ASP	A	147	L	-	O	ALA	V	370
R	-	C	ASP	A	147	L	-	HA	ALA	V	370
R	-	CB	ASP	A	147	L	-	O	ALA	V	370
R	-	O	ASP	A	147	L	-	HA	ALA	V	370
R	-	CG	ASP	A	147	L	-	O	ALA	V	370
R	-	CG	ASP	A	147	L	-	HA2	GLY	V	371
R	-	OD1	ASP	A	147	L	-	O	ALA	V	370
R	-	OD1	ASP	A	147	L	-	HA2	GLY	V	371
R	-	OD1	ASP	A	147	L	-	HA3	GLY	V	371
R	-	OD2	ASP	A	147	L	-	HA2	GLY	V	371
R	-	N	THR	A	148	L	-	O	LEU	V	369
R	-	N	THR	A	148	L	-	CA	ALA	V	370
R	-	N	THR	A	148	L	-	C	ALA	V	370
R	-	N	THR	A	148	L	-	CB	ALA	V	370
R	-	N	THR	A	148	L	-	O	ALA	V	370
R	-	N	THR	A	148	L	-	HA	ALA	V	370
R	-	N	THR	A	148	L	-	HB1	ALA	V	370
R	-	N	THR	A	148	L	-	HB3	ALA	V	370
R	-	CA	THR	A	148	L	-	HA	ALA	V	370
R	-	CA	THR	A	148	L	-	HB1	ALA	V	370
R	-	C	THR	A	148	L	-	CB	ALA	V	370
R	-	C	THR	A	148	L	-	HB1	ALA	V	370
R	-	C	THR	A	148	L	-	HB3	ALA	V	370
R	-	O	THR	A	148	L	-	CB	ALA	V	370
R	-	O	THR	A	148	L	-	HA	ALA	V	370
R	-	O	THR	A	148	L	-	HB1	ALA	V	370
R	-	O	THR	A	148	L	-	HB2	ALA	V	370
R	-	O	THR	A	148	L	-	HB3	ALA	V	370
R	-	OG1	THR	A	148	L	-	O	LEU	V	369
R	-	OG1	THR	A	148	L	-	HB3	LEU	V	369
R	-	OG1	THR	A	148	L	-	HA	ALA	V	370
R	-	OG1	THR	A	148	L	-	HB3	ALA	V	370
R	-	CG1	ILE	A	150	L	H	O	SER	V	366
R	-	CG1	ILE	A	150	L	H	HB3	SER	V	366
R	-	CG1	ILE	A	150	L	H	HA	ALA	V	367
R	-	CD1	ILE	A	150	L	H	CA	SER	V	366
R	-	CD1	ILE	A	150	L	H	C	SER	V	366
R	-	CD1	ILE	A	150	L	H	CB	SER	V	366
R	-	CD1	ILE	A	150	L	H	O	SER	V	366
R	-	CD1	ILE	A	150	L	H	HB2	SER	V	366
R	-	CD1	ILE	A	150	L	H	HB3	SER	V	366
R	-	CD1	ILE	A	150	L	H	N	ALA	V	367
R	-	CD1	ILE	A	150	L	H	CA	ALA	V	367
R	-	CD1	ILE	A	150	L	H	HA	ALA	V	367
R	-	CD1	ILE	A	150	L	H	HB2	ALA	V	367
R	-	CB	ASP	A	160	L	-	HZ3	LYS	V	401
R	-	CG	ASP	A	160	L	-	CE	LYS	V	401
R	-	CG	ASP	A	160	L	-	NZ	LYS	V	401
R	-	CG	ASP	A	160	L	-	HD2	LYS	V	401
R	-	CG	ASP	A	160	L	-	HZ1	LYS	V	401
R	-	CG	ASP	A	160	L	-	HZ2	LYS	V	401
R	-	CG	ASP	A	160	L	-	HZ3	LYS	V	401
R	-	OD1	ASP	A	160	L	-	CD	LYS	V	401
R	-	OD1	ASP	A	160	L	-	CE	LYS	V	401
R	-	OD1	ASP	A	160	L	-	NZ	LYS	V	401
R	-	OD1	ASP	A	160	L	-	HD2	LYS	V	401
R	-	OD1	ASP	A	160	L	-	HE3	LYS	V	401
R	-	OD1	ASP	A	160	L	-	HZ1	LYS	V	401
R	-	OD1	ASP	A	160	L	-	HZ2	LYS	V	401
R	-	OD1	ASP	A	160	L	-	HZ3	LYS	V	401
R	-	OD2	ASP	A	160	L	-	CE	LYS	V	401
R	-	OD2	ASP	A	160	L	-	NZ	LYS	V	401
R	-	OD2	ASP	A	160	L	-	HD2	LYS	V	401
R	-	OD2	ASP	A	160	L	-	HZ1	LYS	V	401
R	-	OD2	ASP	A	160	L	-	HZ2	LYS	V	401
R	-	OD2	ASP	A	160	L	-	HZ3	LYS	V	401
R	-	CE2	TRP	A	163	L	-	HB2	LEU	V	396
R	-	CE3	TRP	A	163	L	-	HB2	ASP	V	394
R	-	NE1	TRP	A	163	L	-	HB2	LEU	V	396
R	-	CH2	TRP	A	163	L	-	CA	ASP	V	394
R	-	CH2	TRP	A	163	L	-	C	ASP	V	394
R	-	CH2	TRP	A	163	L	-	CB	ASP	V	394
R	-	CH2	TRP	A	163	L	-	O	ASP	V	394
R	-	CH2	TRP	A	163	L	-	CG	ASP	V	394
R	-	CH2	TRP	A	163	L	-	OD2	ASP	V	394
R	-	CH2	TRP	A	163	L	-	HB2	ASP	V	394
R	-	CH2	TRP	A	163	L	-	HB3	ASP	V	394
R	-	CH2	TRP	A	163	L	-	O	VAL	V	395
R	-	CZ2	TRP	A	163	L	-	CB	ASP	V	394
R	-	CZ2	TRP	A	163	L	-	HB2	ASP	V	394
R	-	CZ2	TRP	A	163	L	-	HB3	ASP	V	394
R	-	CZ2	TRP	A	163	L	-	C	VAL	V	395
R	-	CZ2	TRP	A	163	L	-	O	VAL	V	395
R	-	CZ2	TRP	A	163	L	-	N	LEU	V	396
R	-	CZ2	TRP	A	163	L	-	H	LEU	V	396
R	-	CZ2	TRP	A	163	L	-	HB2	LEU	V	396
R	-	CZ3	TRP	A	163	L	-	CB	ASP	V	394
R	-	CZ3	TRP	A	163	L	-	CG	ASP	V	394
R	-	CZ3	TRP	A	163	L	-	OD2	ASP	V	394
R	-	CZ3	TRP	A	163	L	-	HB2	ASP	V	394
R	-	CZ3	TRP	A	163	L	-	HB3	ASP	V	394
R	S	CB	PHE	A	165	L	-	OE2	GLU	V	392
R	S	CG	PHE	A	165	L	-	CD	GLU	V	392
R	S	CG	PHE	A	165	L	-	OE1	GLU	V	392
R	S	CG	PHE	A	165	L	-	OE2	GLU	V	392
R	S	CD1	PHE	A	165	L	-	CD	GLU	V	392
R	S	CD1	PHE	A	165	L	-	OE1	GLU	V	392
R	S	CD1	PHE	A	165	L	-	OE2	GLU	V	392
R	S	CD2	PHE	A	165	L	-	CD	GLU	V	392
R	S	CD2	PHE	A	165	L	-	OE1	GLU	V	392
R	S	CD2	PHE	A	165	L	-	OE2	GLU	V	392
R	S	CD2	PHE	A	165	L	-	HB3	GLU	V	392
R	S	CE1	PHE	A	165	L	-	CD	GLU	V	392
R	S	CE1	PHE	A	165	L	-	OE1	GLU	V	392
R	S	CE1	PHE	A	165	L	-	OE2	GLU	V	392
R	S	CE2	PHE	A	165	L	-	CD	GLU	V	392
R	S	CE2	PHE	A	165	L	-	OE1	GLU	V	392
R	S	CE2	PHE	A	165	L	-	OE2	GLU	V	392
R	S	CZ	PHE	A	165	L	-	CD	GLU	V	392
R	S	CZ	PHE	A	165	L	-	OE1	GLU	V	392
R	S	OG1	THR	A	167	L	-	OG1	THR	V	390
R	S	OG1	THR	A	167	L	-	HG21	THR	V	390
R	S	NH1	ARG	A	171	L	-	HB3	LEU	V	384
R	S	NH1	ARG	A	171	L	-	HD13	LEU	V	384
R	S	NH1	ARG	A	171	L	-	CG2	VAL	V	386
R	S	NH1	ARG	A	171	L	-	HB	VAL	V	386
R	S	NH1	ARG	A	171	L	-	HG21	VAL	V	386
R	S	NH1	ARG	A	171	L	-	HG23	VAL	V	386
R	S	NH2	ARG	A	171	L	-	CB	VAL	V	386
R	S	NH2	ARG	A	171	L	-	CG1	VAL	V	386
R	S	NH2	ARG	A	171	L	-	CG2	VAL	V	386
R	S	NH2	ARG	A	171	L	-	HB	VAL	V	386
R	S	NH2	ARG	A	171	L	-	HG12	VAL	V	386
R	S	NH2	ARG	A	171	L	-	HG21	VAL	V	386
R	S	NH2	ARG	A	171	L	-	HG22	VAL	V	386
R	S	NH2	ARG	A	171	L	-	HG23	VAL	V	386
R	S	CZ	ARG	A	171	L	-	CG2	VAL	V	386
R	S	CZ	ARG	A	171	L	-	HB	VAL	V	386
R	S	CZ	ARG	A	171	L	-	HG21	VAL	V	386
R	S	CZ	ARG	A	171	L	-	HG23	VAL	V	386
R	S	CB	CYS	A	195	L	-	HB2	LEU	V	389
R	S	CB	CYS	A	195	L	-	HG1	THR	V	390
R	S	SG	CYS	A	195	L	-	O	HIS	V	388
R	S	SG	CYS	A	195	L	-	HB2	LEU	V	389
R	H	OE1	GLU	A	207	L	H	HD2	ARG	V	363
R	-	OH	TYR	A	222	L	-	O	GLU	V	392
R	-	CZ	TYR	A	222	L	-	O	GLU	V	392
R	-	CA	SER	A	224	L	-	O	HIS	V	388
R	-	CA	SER	A	224	L	-	O	LEU	V	389
R	-	CB	SER	A	224	L	-	N	HIS	V	388
R	-	CB	SER	A	224	L	-	C	HIS	V	388
R	-	CB	SER	A	224	L	-	O	HIS	V	388
R	-	CB	SER	A	224	L	-	H	HIS	V	388
R	-	CB	SER	A	224	L	-	N	LEU	V	389
R	-	CB	SER	A	224	L	-	C	LEU	V	389
R	-	CB	SER	A	224	L	-	O	LEU	V	389
R	-	O	SER	A	224	L	-	O	HIS	V	388
R	-	O	SER	A	224	L	-	H	HIS	V	388
R	-	OG	SER	A	224	L	-	CA	ASN	V	387
R	-	OG	SER	A	224	L	-	C	ASN	V	387
R	-	OG	SER	A	224	L	-	HA	ASN	V	387
R	-	OG	SER	A	224	L	-	HB3	ASN	V	387
R	-	OG	SER	A	224	L	-	N	HIS	V	388
R	-	OG	SER	A	224	L	-	CA	HIS	V	388
R	-	OG	SER	A	224	L	-	C	HIS	V	388
R	-	OG	SER	A	224	L	-	O	HIS	V	388
R	-	OG	SER	A	224	L	-	H	HIS	V	388
R	-	OG	SER	A	224	L	-	O	LEU	V	389
R	-	CG	ARG	A	225	L	-	OD1	ASN	V	387
R	-	CG	ARG	A	225	L	-	HA	ASN	V	387
R	-	CD	ARG	A	225	L	-	CG	ASN	V	387
R	-	CD	ARG	A	225	L	-	OD1	ASN	V	387
R	-	NE	ARG	A	225	L	-	OD1	ASN	V	387
R	-	NH1	ARG	A	225	L	-	HA	SER	V	385
R	-	NH1	ARG	A	225	L	-	HB2	SER	V	385
R	-	NH1	ARG	A	225	L	-	CG	ASN	V	387
R	-	NH1	ARG	A	225	L	-	OD1	ASN	V	387
R	-	CZ	ARG	A	225	L	-	OD1	ASN	V	387
R	S	CD1	TYR	A	271	L	-	HD2	HIS	V	388
R	S	CD1	TYR	A	271	L	-	HE2	HIS	V	388
R	S	CD1	TYR	A	271	L	-	HD12	LEU	V	389
R	S	CE1	TYR	A	271	L	-	CD2	HIS	V	388
R	S	CE1	TYR	A	271	L	-	HD2	HIS	V	388
R	S	CE1	TYR	A	271	L	-	HE2	HIS	V	388
R	S	CE1	TYR	A	271	L	-	CD1	LEU	V	389
R	S	CE1	TYR	A	271	L	-	HD11	LEU	V	389
R	S	CE1	TYR	A	271	L	-	HD12	LEU	V	389
R	S	CE1	TYR	A	271	L	-	HD13	LEU	V	389
R	S	CE2	TYR	A	271	L	-	HD2	HIS	V	388
R	S	OH	TYR	A	271	L	-	HD2	HIS	V	388
R	S	OH	TYR	A	271	L	-	CD1	LEU	V	389
R	S	OH	TYR	A	271	L	-	HD11	LEU	V	389
R	S	OH	TYR	A	271	L	-	HD12	LEU	V	389
R	S	OH	TYR	A	271	L	-	HD13	LEU	V	389
R	S	CZ	TYR	A	271	L	-	HD2	HIS	V	388
R	S	CZ	TYR	A	271	L	-	HD11	LEU	V	389
R	S	CZ	TYR	A	271	L	-	HD12	LEU	V	389
R	S	CD	GLU	A	273	L	-	HD12	LEU	V	389
R	S	CD	GLU	A	273	L	-	HD13	LEU	V	389
R	S	OE2	GLU	A	273	L	-	CG	LEU	V	389
R	S	OE2	GLU	A	273	L	-	CD1	LEU	V	389
R	S	OE2	GLU	A	273	L	-	CD2	LEU	V	389
R	S	OE2	GLU	A	273	L	-	HD11	LEU	V	389
R	S	OE2	GLU	A	273	L	-	HD12	LEU	V	389
R	S	OE2	GLU	A	273	L	-	HD13	LEU	V	389
R	S	OE2	GLU	A	273	L	-	HD22	LEU	V	389
R	S	OE2	GLU	A	273	L	-	HD23	LEU	V	389
R	-	CZ2	TRP	A	283	L	-	HD12	LEU	V	400

- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
- In the Secondary Structure columns: 'H' means that residues/atoms in that row are part of Alpha Helix; 'S' - Beta Sheet

Krembil, Jurisica Lab. July 16, 2025 Database: 1.0.4.1